2-[(2-ethyl-1-oxidanylidene-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(2-ethyl-1-oxidanylidene-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(2-ethyl-1-oxo-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(2-ethyl-1-oxo-4-spiro[4H-isoquinoline-3,1'-cyclohexane]yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(2-ethyl-1-oxospiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(2-ethyl-1-keto-spiro[4H-isoquinoline-3,1'-cyclohexane]-4-yl)methyl]isoindoline-1,3-quinone Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(C13CCCCC3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(C13CCCCC3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H26N2O3/c1-2-27-24(30)18-11-5-4-10-17(18)21(25(27)14-8-3-9-15-25)16-26-22(28)19-12-6-7-13-20(19)23(26)29/h4-7,10-13,21H,2-3,8-9,14-16H2,1H3